[(2S)-oxolan-2-yl]methyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: [(2S)-oxolan-2-yl]methyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: [(2S)-tetrahydrofuran-2-yl]methyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(3-methoxy-4-propoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid [(2S)-2-oxolanyl]methyl ester IUPAC Name: [(2S)-oxolan-2-yl]methyl (4S,5R)-4-(3-methoxy-4-propoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-2-keto-4-(3-methoxy-4-propoxy-phenyl)-6-methylene-hexahydropyrimidine-5-carboxylic acid [(2S)-tetrahydrofuran-2-yl]methyl ester Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OCC3CCCO3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC[C@@H]3CCCO3)OC

InChI

InChI=1S/C21H28N2O6/c1-4-9-28-16-8-7-14(11-17(16)26-3)19-18(13(2)22-21(25)23-19)20(24)29-12-15-6-5-10-27-15/h7-8,11,15,18-19H,2,4-6,9-10,12H2,1,3H3,(H2,22,23,25)/t15-,18-,19+/m0/s1